Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 8/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.39 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.39 |
| ▸ | PPID | Q08752 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5214027 | 0.81 | NPC1 (0.53) | HPGDNPC1RAB9AMEN1KMT2A | |
| SCHEMBL5208438 | 0.81 | FAAH (0.54) | SMN1; SMN2MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL5193934 | 0.72 | ALDH1A1 (0.53) | HPGDHTTALOX15MEN1KMT2A | |
| SCHEMBL16250732 | 0.69 | MAPK14 (0.54) | HPGDSMN1; SMN2ALOX12MAPK14HTT | |
| SCHEMBL2917177 | 0.69 | REN (0.35) | CYP1A2CYP2C19ALOX15LMNA | |
| SCHEMBL5192010 | 0.68 | HPGD (0.46) | HPGDSMN1; SMN2NOS2MEN1KMT2A | |
| SCHEMBL27393194 | 0.68 | MAPK14 (0.52) | HPGDSMN1; SMN2ALOX12MAPK14HTT | |
| SCHEMBL5191071 | 0.67 | LMNA (0.47) | MEN1KMT2ALMNA | |
| SCHEMBL5192873 | 0.67 | LMNA (0.47) | MEN1KMT2ALMNA | |
| SCHEMBL20051408 | 0.67 | MAPK14 (0.54) | HPGDSMN1; SMN2ALOX12MAPK14HTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0968206-B8 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX INC (US) | 2007-01-24 | — | — | EP | disclosed |
| EP-0968206-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037079-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1998-08-27 | — | — | WO | disclosed |